#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fh0 s GLU 37 N 0.00 3.34 -1.02 1.61 2.12 -1.26 -4.95 118.70 118.54 2fh0 s GLU 37 Ca 0.00 -0.93 -0.11 0.00 0.36 0.00 0.00 54.97 54.29 2fh0 s GLU 37 Cb 0.00 -4.62 0.25 0.00 0.26 0.00 0.00 34.13 30.01 2fh0 s GLU 37 CO 0.00 -1.99 1.02 -0.80 -0.54 0.00 0.00 175.26 172.95 2fh0 s ASN 38 N 4.00 7.10 -0.05 -1.70 -0.87 -1.26 -4.99 114.94 117.17 2fh0 s ASN 38 Ca 0.33 -3.20 -0.04 0.00 -1.57 0.00 0.00 52.86 48.38 2fh0 s ASN 38 Cb -0.08 -2.23 0.02 0.00 -0.02 0.00 0.00 41.25 38.94 2fh0 s ASN 38 CO 0.03 -0.44 0.12 -0.44 -2.57 0.00 0.00 177.10 173.80 2fh0 s SER 39 N 1.79 -0.12 -0.59 -1.22 0.01 -1.26 -5.11 113.70 107.19 2fh0 s SER 39 Ca 0.28 0.25 0.01 0.00 1.31 0.00 0.00 55.95 57.79 2fh0 s SER 39 Cb -0.09 0.23 0.15 0.00 0.21 0.00 0.00 66.02 66.51 2fh0 s SER 39 CO -0.08 -0.07 0.37 0.00 0.41 0.00 0.00 173.24 173.88 2fh0 s ALA 40 N 0.32 3.49 0.50 1.44 0.00 -1.26 -5.10 121.76 121.16 2fh0 s ALA 40 Ca -0.02 -3.32 -0.22 0.00 0.00 0.00 0.00 51.96 48.40 2fh0 s ALA 40 Cb -0.03 -2.42 -0.08 0.00 0.00 0.00 0.00 23.12 20.59 2fh0 s ALA 40 CO -0.01 -2.07 0.97 -2.30 0.00 0.00 0.00 175.76 172.34 2fh0 n PRO 41 N 3.19 1.15 -3.48 0.00 -0.02 -1.26 -5.00 135.00 129.58 2fh0 n PRO 41 Ca 0.08 0.42 -0.28 0.00 -2.02 0.00 0.00 63.50 61.69 2fh0 n PRO 41 Cb 0.35 -2.08 -0.11 0.00 -0.02 0.00 0.00 33.50 31.63 2fh0 n PRO 41 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2fh0 s VAL 42 N -1.40 0.39 0.00 -1.45 -7.23 -1.26 -4.85 120.40 104.60 2fh0 s VAL 42 Ca 0.68 -2.15 0.00 0.00 -1.81 0.00 0.00 61.98 58.70 2fh0 s VAL 42 Cb -0.49 -1.29 0.00 0.00 0.56 0.00 0.00 36.38 35.16 2fh0 s VAL 42 CO 0.53 -1.06 0.00 0.61 -0.31 0.00 0.00 175.10 174.87 2fh0 n GLY 43 N 3.57 3.06 0.23 2.32 0.00 -1.26 -4.85 105.19 108.26 2fh0 n GLY 43 Ca 0.17 -0.88 -0.05 0.00 0.00 0.00 0.00 46.02 45.27 2fh0 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fh0 h ALA 44 N 0.00 1.01 -0.86 4.61 0.00 -1.99 -1.96 119.26 120.07 2fh0 h ALA 44 Ca 0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2fh0 h ALA 44 Cb 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2fh0 h ALA 44 CO 0.00 0.60 0.47 0.00 0.00 0.00 0.00 179.25 180.32 2fh0 h ALA 45 N 1.23 1.22 0.00 0.00 0.00 -1.88 -2.41 119.26 117.42 2fh0 h ALA 45 Ca 0.05 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2fh0 h ALA 45 Cb 0.76 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2fh0 h ALA 45 CO 0.06 0.63 -0.63 -0.84 0.00 0.00 0.00 179.25 178.47 2fh0 h ILE 46 N 1.19 0.87 -0.31 0.00 3.07 -1.95 -3.13 117.51 117.25 2fh0 h ILE 46 Ca 0.30 -2.26 -0.06 0.00 1.55 0.00 0.00 64.86 64.40 2fh0 h ILE 46 Cb 0.02 2.40 -0.02 0.00 -0.27 0.00 0.00 36.82 38.95 2fh0 h ILE 46 CO -0.05 0.49 -0.06 0.00 -1.05 0.00 0.00 178.15 177.49 2fh0 h ALA 47 N 1.46 1.32 0.00 0.16 0.00 -0.87 -2.60 119.26 118.74 2fh0 h ALA 47 Ca -0.02 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.47 2fh0 h ALA 47 Cb 1.43 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2fh0 h ALA 47 CO 0.07 0.46 -0.95 -0.91 0.00 0.00 0.00 179.25 177.92 2fh0 h ASN 48 N 0.48 0.00 0.05 0.00 2.35 -1.53 -3.26 115.58 113.66 2fh0 h ASN 48 Ca 0.10 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 2fh0 h ASN 48 Cb 0.40 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 2fh0 h ASN 48 CO 0.02 0.84 -0.05 -0.26 -1.65 0.00 0.00 177.43 176.33 2fh0 h PHE 49 N 0.00 0.00 -3.55 1.19 -1.00 -1.41 -3.43 116.94 108.74 2fh0 h PHE 49 Ca -0.04 0.00 -0.42 0.00 2.81 0.00 0.00 57.97 60.32 2fh0 h PHE 49 Cb 1.68 0.00 0.19 0.00 3.61 0.00 0.00 35.95 41.43 2fh0 h PHE 49 CO 0.00 0.05 0.18 -0.51 -1.61 0.00 0.00 178.31 176.42 2fh0 s LEU 50 N -8.93 1.01 0.11 1.54 1.02 -1.15 -3.97 118.68 108.30 2fh0 s LEU 50 Ca -0.05 0.48 0.05 0.00 0.02 0.00 0.00 54.13 54.64 2fh0 s LEU 50 Cb 0.17 -2.22 -0.04 0.00 0.02 0.00 0.00 46.19 44.12 2fh0 s LEU 50 CO 0.68 -3.98 -0.13 -1.61 0.02 0.00 0.00 176.35 171.33 2fh0 s GLU 51 N -5.56 0.96 0.22 1.70 0.41 -1.26 -4.90 118.70 110.26 2fh0 s GLU 51 Ca 0.72 -1.20 -0.08 0.00 -0.41 0.00 0.00 54.97 54.00 2fh0 s GLU 51 Cb -0.07 -0.78 0.32 0.00 -1.78 0.00 0.00 34.13 31.82 2fh0 s GLU 51 CO 0.55 0.14 1.75 -1.35 -0.49 0.00 0.00 175.26 175.86 2fh0 h PRO 52 N 3.57 0.43 -0.13 0.39 0.11 -1.98 0.35 132.00 134.73 2fh0 h PRO 52 Ca -0.39 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.64 2fh0 h PRO 52 Cb 1.19 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2fh0 h PRO 52 CO 0.51 0.29 -0.13 1.96 -0.21 0.00 0.00 178.00 180.41 2fh0 h GLN 53 N 0.44 0.33 -0.48 1.05 4.20 -2.01 -3.00 115.11 115.65 2fh0 h GLN 53 Ca 0.33 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 2fh0 h GLN 53 Cb 0.42 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 2fh0 h GLN 53 CO -0.32 0.72 0.26 0.00 -0.67 0.00 0.00 178.83 178.82 2fh0 h ALA 54 N 0.60 1.56 -0.89 3.87 0.00 -1.77 -2.19 119.26 120.45 2fh0 h ALA 54 Ca 0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2fh0 h ALA 54 Cb 0.65 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2fh0 h ALA 54 CO 0.03 0.37 0.49 1.25 0.00 0.00 0.00 179.25 181.39 2fh0 h LEU 55 N 0.66 1.10 -0.21 0.00 5.85 -0.25 -2.12 115.31 120.34 2fh0 h LEU 55 Ca 0.17 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2fh0 h LEU 55 Cb 0.02 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 2fh0 h LEU 55 CO -0.03 0.88 0.11 -0.08 -0.34 0.00 0.00 178.44 178.99 2fh0 h GLU 56 N 1.24 0.29 -0.37 1.25 4.81 -1.26 0.66 114.58 121.21 2fh0 h GLU 56 Ca 0.31 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.53 2fh0 h GLU 56 Cb 0.02 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 2fh0 h GLU 56 CO -0.05 0.27 0.21 -0.09 -0.73 0.00 0.00 179.01 178.62 2fh0 h ARG 57 N 0.23 0.42 -0.59 1.92 9.65 -1.36 0.09 114.38 124.73 2fh0 h ARG 57 Ca 0.07 -0.03 -0.07 0.00 -1.10 0.00 0.00 59.98 58.86 2fh0 h ARG 57 Cb 0.07 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.53 2fh0 h ARG 57 CO -0.01 0.28 0.10 1.25 2.80 0.00 0.00 179.97 184.38 2fh0 h LEU 58 N 0.43 0.90 -0.35 3.80 5.85 -1.23 -0.63 115.31 124.09 2fh0 h LEU 58 Ca 0.15 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 2fh0 h LEU 58 Cb 0.01 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 2fh0 h LEU 58 CO -0.07 0.91 0.04 0.28 -0.34 0.00 0.00 178.44 179.26 2fh0 h SER 59 N 0.90 0.56 -0.29 1.25 0.02 -0.40 0.20 113.55 115.79 2fh0 h SER 59 Ca 0.18 -0.27 -0.05 0.00 -0.84 0.00 0.00 61.79 60.81 2fh0 h SER 59 Cb 0.39 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 2fh0 h SER 59 CO 0.01 0.69 -0.03 -0.09 -1.14 0.00 0.00 176.83 176.28 2fh0 h ARG 60 N 0.42 0.53 -0.44 3.45 2.43 -0.83 -2.83 114.38 117.11 2fh0 h ARG 60 Ca 0.10 -0.18 -0.14 0.00 -0.81 0.00 0.00 59.98 58.95 2fh0 h ARG 60 Cb 0.38 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2fh0 h ARG 60 CO 0.01 0.70 -0.26 -0.24 -1.51 0.00 0.00 179.97 178.67 2fh0 h VAL 61 N 0.31 1.27 -0.17 0.20 3.04 -1.08 -2.96 116.25 116.85 2fh0 h VAL 61 Ca 0.08 -1.42 0.05 0.00 -1.01 0.00 0.00 66.70 64.40 2fh0 h VAL 61 Cb 0.48 1.22 -0.01 0.00 -2.01 0.00 0.00 31.29 30.98 2fh0 h VAL 61 CO 0.02 0.48 0.13 0.00 -1.01 0.00 0.00 177.57 177.19 2fh0 h ALA 62 N 0.83 2.16 -0.35 3.17 0.00 -0.57 0.18 119.26 124.68 2fh0 h ALA 62 Ca 0.09 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2fh0 h ALA 62 Cb 0.84 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2fh0 h ALA 62 CO 0.07 -0.21 0.04 -0.07 0.00 0.00 0.00 179.25 179.09 2fh0 h LEU 63 N 0.01 0.48 0.00 0.00 3.38 -1.32 -2.87 115.31 114.98 2fh0 h LEU 63 Ca 0.08 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2fh0 h LEU 63 Cb 0.32 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2fh0 h LEU 63 CO -0.00 0.52 -0.96 0.52 0.09 0.00 0.00 178.44 178.61 2fh0 n VAL 64 N -4.31 1.47 -3.80 1.22 0.31 -0.45 -4.83 118.33 107.94 2fh0 n VAL 64 Ca 0.02 0.10 -0.30 0.00 -0.01 0.00 0.00 64.34 64.15 2fh0 n VAL 64 Cb 0.21 -2.27 -0.13 0.00 -0.91 0.00 0.00 33.84 30.74 2fh0 n VAL 64 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2fh0 s ARG 65 N -2.46 1.58 0.47 5.55 1.81 0.51 -4.96 118.95 121.45 2fh0 s ARG 65 Ca -0.23 -2.29 0.13 0.00 -1.72 0.00 0.00 55.73 51.62 2fh0 s ARG 65 Cb 0.04 -2.72 1.09 0.00 -0.45 0.00 0.00 34.95 32.92 2fh0 s ARG 65 CO 0.36 -1.15 2.09 0.07 -0.68 0.00 0.00 175.30 175.98 2fh0 h ARG 66 N 6.56 0.25 -0.78 3.54 -0.00 -1.68 -2.30 114.38 119.96 2fh0 h ARG 66 Ca -0.02 -0.02 0.07 0.00 -0.00 0.00 0.00 59.98 60.02 2fh0 h ARG 66 Cb 0.91 -0.06 -0.06 0.00 -0.00 0.00 0.00 29.97 30.75 2fh0 h ARG 66 CO 0.56 0.17 0.46 0.38 -0.00 0.00 0.00 179.97 181.54 2fh0 h ASP 67 N 0.26 0.68 -0.10 0.08 2.03 -1.93 0.58 116.42 118.02 2fh0 h ASP 67 Ca 0.11 0.03 -0.01 0.00 -0.73 0.00 0.00 57.03 56.43 2fh0 h ASP 67 Cb 0.10 -0.10 -0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2fh0 h ASP 67 CO -0.02 0.42 0.00 0.03 -1.03 0.00 0.00 179.24 178.64 2fh0 h ARG 68 N 0.81 0.17 -0.64 4.15 3.08 -1.79 -2.11 114.38 118.05 2fh0 h ARG 68 Ca 0.36 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.28 2fh0 h ARG 68 Cb 0.25 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 2fh0 h ARG 68 CO -0.21 0.41 0.08 0.00 -1.07 0.00 0.00 179.97 179.19 2fh0 h ALA 69 N 0.75 0.92 -0.32 0.04 0.00 -1.36 -2.45 119.26 116.84 2fh0 h ALA 69 Ca 0.03 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2fh0 h ALA 69 Cb 0.34 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2fh0 h ALA 69 CO 0.00 0.66 -0.03 -0.56 0.00 0.00 0.00 179.25 179.33 2fh0 h GLN 70 N 1.00 0.50 -0.00 0.00 -0.00 0.17 -2.21 115.11 114.57 2fh0 h GLN 70 Ca 0.19 -0.11 -0.13 0.00 -0.00 0.00 0.00 58.65 58.60 2fh0 h GLN 70 Cb 0.46 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.48 27.85 2fh0 h GLN 70 CO 0.02 0.55 -0.63 0.00 -0.00 0.00 0.00 178.83 178.77 2fh0 h ALA 71 N 1.50 0.95 -0.06 0.06 0.00 -1.11 -1.20 119.26 119.39 2fh0 h ALA 71 Ca 0.10 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 2fh0 h ALA 71 Cb 0.35 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2fh0 h ALA 71 CO 0.01 0.79 -0.03 0.28 0.00 0.00 0.00 179.25 180.30 2fh0 h VAL 72 N 0.01 1.33 -0.40 0.00 2.07 -0.94 0.17 116.25 118.48 2fh0 h VAL 72 Ca -0.01 -1.05 -0.14 0.00 0.82 0.00 0.00 66.70 66.33 2fh0 h VAL 72 Cb 1.12 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.79 2fh0 h VAL 72 CO 0.08 0.29 -0.30 1.05 0.02 0.00 0.00 177.57 178.71 2fh0 h GLU 73 N -0.27 0.89 -0.09 1.57 -0.00 -1.47 -2.38 114.58 112.83 2fh0 h GLU 73 Ca 0.01 -0.42 -0.11 0.00 -0.00 0.00 0.00 59.36 58.84 2fh0 h GLU 73 Cb 0.47 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 29.20 2fh0 h GLU 73 CO 0.01 1.07 -0.46 1.15 -0.00 0.00 0.00 179.01 180.77 2fh0 h THR 74 N 0.75 1.33 -0.20 -1.06 2.02 -1.23 -2.82 112.91 111.70 2fh0 h THR 74 Ca 0.08 -1.64 -0.03 0.00 0.77 0.00 0.00 66.41 65.59 2fh0 h THR 74 Cb 0.87 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 2fh0 h THR 74 CO 0.08 0.49 -0.01 0.22 0.37 0.00 0.00 175.52 176.67 2fh0 h TYR 75 N 0.17 0.40 -0.39 3.16 5.03 -0.49 -2.20 116.97 122.65 2fh0 h TYR 75 Ca 0.01 -0.07 0.00 0.00 2.58 0.00 0.00 58.73 61.25 2fh0 h TYR 75 Cb 0.88 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 39.04 2fh0 h TYR 75 CO 0.01 0.56 0.26 1.25 -1.32 0.00 0.00 178.16 178.92 2fh0 h LEU 76 N 0.12 0.45 -1.36 2.82 5.85 -1.38 -2.05 115.31 119.76 2fh0 h LEU 76 Ca 0.06 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2fh0 h LEU 76 Cb 0.41 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2fh0 h LEU 76 CO 0.01 0.32 0.09 0.07 -0.34 0.00 0.00 178.44 178.59 2fh0 h LYS 77 N 0.53 0.51 -0.40 1.25 2.10 -1.49 -2.12 116.57 116.95 2fh0 h LYS 77 Ca 0.14 -0.08 -0.03 0.00 -2.00 0.00 0.00 60.65 58.68 2fh0 h LYS 77 Cb -0.06 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.16 2fh0 h LYS 77 CO -0.03 0.48 0.14 -0.22 -2.00 0.00 0.00 179.45 177.81 2fh0 h LYS 78 N 0.51 0.62 -0.72 0.07 3.64 -0.84 -1.01 116.57 118.83 2fh0 h LYS 78 Ca 0.12 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2fh0 h LYS 78 Cb 0.20 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 2fh0 h LYS 78 CO -0.00 0.61 0.43 -0.07 -2.27 0.00 0.00 179.45 178.15 2fh0 h LEU 79 N 0.51 0.86 -0.48 5.20 4.07 -0.92 -1.28 115.31 123.28 2fh0 h LEU 79 Ca 0.13 -0.06 -0.05 0.00 0.08 0.00 0.00 57.88 57.98 2fh0 h LEU 79 Cb 0.24 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.74 2fh0 h LEU 79 CO -0.01 0.67 0.09 0.40 -1.08 0.00 0.00 178.44 178.51 2fh0 h ILE 80 N 0.98 1.25 0.00 1.22 2.04 -1.18 0.32 117.51 122.13 2fh0 h ILE 80 Ca 0.26 -0.90 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 2fh0 h ILE 80 Cb -0.04 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2fh0 h ILE 80 CO -0.05 0.32 -0.25 0.00 0.00 0.00 0.00 178.15 178.17 2fh0 h ALA 81 N 0.96 1.56 0.00 1.87 0.00 -0.90 -3.30 119.26 119.45 2fh0 h ALA 81 Ca 0.15 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2fh0 h ALA 81 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2fh0 h ALA 81 CO 0.01 0.31 -0.17 1.15 0.00 0.00 0.00 179.25 180.55 2fh0 h THR 82 N 0.00 0.00 0.00 0.00 2.02 -0.94 -3.50 112.91 110.50 2fh0 h THR 82 Ca -0.00 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2fh0 h THR 82 Cb 0.45 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 2fh0 h THR 82 CO 0.03 0.00 0.00 -0.46 0.37 0.00 0.00 175.52 175.46 2fh0 n ASN 83 N -4.00 0.00 -4.54 4.18 6.94 0.73 -5.10 115.26 113.47 2fh0 n ASN 83 Ca -0.02 0.00 -0.32 0.00 -0.02 0.00 0.00 54.58 54.21 2fh0 n ASN 83 Cb 0.09 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.45 2fh0 n ASN 83 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2fh0 n ASN 84 N 0.00 1.79 -3.06 0.53 3.02 0.76 -4.80 115.26 113.51 2fh0 n ASN 84 Ca 0.00 -0.59 -0.17 0.00 -0.03 0.00 0.00 54.58 53.79 2fh0 n ASN 84 Cb 0.00 -1.47 -0.04 0.00 -0.61 0.00 0.00 39.78 37.67 2fh0 n ASN 84 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2fh0 n VAL 85 N 7.98 -0.56 -2.13 2.41 0.31 -1.26 -3.14 118.33 121.94 2fh0 n VAL 85 Ca 0.44 -2.52 0.01 0.00 -0.01 0.00 0.00 64.34 62.26 2fh0 n VAL 85 Cb 0.44 -0.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 2fh0 n VAL 85 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2fh0 n THR 86 N 2.37 0.00 -3.96 2.52 -2.24 -1.26 -5.12 114.28 106.59 2fh0 n THR 86 Ca 0.21 -0.26 0.02 0.00 -2.27 0.00 0.00 64.05 61.75 2fh0 n THR 86 Cb 0.54 0.62 0.01 0.00 -2.10 0.00 0.00 70.33 69.39 2fh0 n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fh0 n HIS 87 N 0.13 -0.21 -4.58 4.78 1.44 -1.26 -5.19 115.22 110.34 2fh0 n HIS 87 Ca 0.01 -0.36 -0.25 0.00 -2.01 0.00 0.00 57.72 55.10 2fh0 n HIS 87 Cb 0.81 0.16 -0.05 0.00 0.12 0.00 0.00 29.99 31.03 2fh0 n HIS 87 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2fh0 n LYS 88 N -0.52 0.95 0.33 -1.40 5.02 -1.26 -5.08 118.16 116.20 2fh0 n LYS 88 Ca 0.03 -2.96 -0.13 0.00 -2.02 0.00 0.00 58.31 53.23 2fh0 n LYS 88 Cb 0.32 0.91 -0.06 0.00 -0.02 0.00 0.00 35.03 36.18 2fh0 n LYS 88 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2fh0 h ILE 89 N 1.26 0.00 -3.62 -0.18 1.08 -1.91 -3.47 117.51 110.67 2fh0 h ILE 89 Ca -0.33 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.24 2fh0 h ILE 89 Cb 1.02 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.72 2fh0 h ILE 89 CO 0.54 0.00 -1.05 0.35 -0.69 0.00 0.00 178.15 177.30 2fh0 n THR 90 N -4.26 -2.30 0.08 -0.27 -2.24 -1.26 -3.06 114.28 100.96 2fh0 n THR 90 Ca -0.10 1.29 0.01 0.00 -2.27 0.00 0.00 64.05 62.98 2fh0 n THR 90 Cb 0.33 -2.11 0.34 0.00 -2.10 0.00 0.00 70.33 66.79 2fh0 n THR 90 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2fh0 h GLU 91 N -0.30 0.33 -0.15 -0.78 4.11 -1.91 -0.92 114.58 114.95 2fh0 h GLU 91 Ca -0.06 -0.08 -0.06 0.00 0.07 0.00 0.00 59.36 59.22 2fh0 h GLU 91 Cb 1.08 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 2fh0 h GLU 91 CO 0.02 0.46 -0.16 0.00 0.07 0.00 0.00 179.01 179.41 2fh0 h ALA 92 N 1.57 0.22 -0.07 1.06 0.00 -1.99 -2.84 119.26 117.20 2fh0 h ALA 92 Ca 0.06 -0.33 -0.21 0.00 0.00 0.00 0.00 54.91 54.43 2fh0 h ALA 92 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2fh0 h ALA 92 CO 0.02 0.12 -0.82 1.49 0.00 0.00 0.00 179.25 180.06 2fh0 h GLU 93 N 0.01 0.52 -0.75 0.00 4.81 -1.55 -3.13 114.58 114.48 2fh0 h GLU 93 Ca 0.02 -0.47 -0.04 0.00 -0.13 0.00 0.00 59.36 58.75 2fh0 h GLU 93 Cb 0.69 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.15 2fh0 h GLU 93 CO 0.04 1.10 0.33 0.97 -0.73 0.00 0.00 179.01 180.71 2fh0 h ILE 94 N 0.34 1.24 -0.63 2.32 2.10 -1.08 -0.48 117.51 121.32 2fh0 h ILE 94 Ca -0.05 -0.73 -0.04 0.00 1.08 0.00 0.00 64.86 65.11 2fh0 h ILE 94 Cb 1.42 0.32 -0.03 0.00 -1.09 0.00 0.00 36.82 37.45 2fh0 h ILE 94 CO 0.15 0.30 0.23 0.58 -1.08 0.00 0.00 178.15 178.33 2fh0 h VAL 95 N 1.07 1.24 -0.30 2.19 2.07 -1.53 0.96 116.25 121.95 2fh0 h VAL 95 Ca 0.25 -0.78 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 2fh0 h VAL 95 Cb 0.16 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2fh0 h VAL 95 CO -0.03 0.30 0.04 -1.28 0.02 0.00 0.00 177.57 176.62 2fh0 h SER 96 N 0.90 0.49 -0.56 0.57 0.87 -1.40 -0.80 113.55 113.62 2fh0 h SER 96 Ca 0.21 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 2fh0 h SER 96 Cb 0.24 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2fh0 h SER 96 CO -0.01 0.64 0.24 0.40 -0.53 0.00 0.00 176.83 177.57 2fh0 h ILE 97 N 0.32 1.21 -0.87 2.23 2.04 -0.91 -1.51 117.51 120.03 2fh0 h ILE 97 Ca 0.09 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.31 2fh0 h ILE 97 Cb 0.37 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 2fh0 h ILE 97 CO 0.01 0.25 0.55 -0.07 0.00 0.00 0.00 178.15 178.89 2fh0 h LEU 98 N 0.76 1.02 -1.03 1.44 3.38 -0.68 0.89 115.31 121.09 2fh0 h LEU 98 Ca 0.19 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 2fh0 h LEU 98 Cb 0.17 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2fh0 h LEU 98 CO -0.02 0.77 0.10 0.78 0.09 0.00 0.00 178.44 180.16 2fh0 h ASN 99 N 1.19 0.75 0.12 -0.43 2.35 -0.73 -2.64 115.58 116.19 2fh0 h ASN 99 Ca 0.32 -0.14 -0.22 0.00 -0.55 0.00 0.00 56.30 55.71 2fh0 h ASN 99 Cb -0.09 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.09 2fh0 h ASN 99 CO -0.06 0.75 -0.83 1.23 -1.65 0.00 0.00 177.43 176.87 2fh0 h GLY 100 N 0.96 0.62 0.65 2.83 0.00 -0.62 -3.20 103.07 104.30 2fh0 h GLY 100 Ca 0.17 -0.94 0.08 0.00 0.00 0.00 0.00 47.33 46.63 2fh0 h GLY 100 CO 0.00 0.84 0.64 -2.22 0.00 0.00 0.00 176.54 175.80 2fh0 h ILE 101 N 0.36 1.03 -0.96 2.60 2.04 -0.56 -1.33 117.51 120.69 2fh0 h ILE 101 Ca -0.06 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.42 2fh0 h ILE 101 Cb 1.45 -0.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.30 2fh0 h ILE 101 CO 0.15 0.20 0.62 0.00 0.00 0.00 0.00 178.15 179.12 2fh0 h ALA 102 N 1.48 1.22 -0.10 1.87 0.00 -1.48 -1.91 119.26 120.36 2fh0 h ALA 102 Ca 0.45 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 55.16 2fh0 h ALA 102 Cb 0.27 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2fh0 h ALA 102 CO -0.20 0.64 -0.46 -0.22 0.00 0.00 0.00 179.25 179.01 2fh0 h LYS 103 N 1.32 0.23 -0.29 0.00 3.64 -1.33 -3.16 116.57 116.97 2fh0 h LYS 103 Ca 0.35 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.58 2fh0 h LYS 103 Cb -0.12 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2fh0 h LYS 103 CO -0.07 0.65 0.06 1.96 -2.27 0.00 0.00 179.45 179.78 2fh0 h GLN 104 N 0.19 0.48 -7.62 1.90 1.08 -0.56 -3.45 115.11 107.14 2fh0 h GLN 104 Ca 0.01 -0.12 -0.46 0.00 -1.45 0.00 0.00 58.65 56.63 2fh0 h GLN 104 Cb 0.89 -0.06 0.13 0.00 -0.05 0.00 0.00 27.48 28.39 2fh0 h GLN 104 CO 0.07 0.58 0.37 -0.65 -0.95 0.00 0.00 178.83 178.25 2fh0 s GLN 105 N -5.22 1.28 -0.33 1.46 -1.52 -0.84 -4.97 119.66 109.52 2fh0 s GLN 105 Ca -0.13 0.04 0.05 0.00 -1.95 0.00 0.00 55.36 53.36 2fh0 s GLN 105 Cb 0.08 -1.88 0.56 0.00 -0.22 0.00 0.00 33.01 31.56 2fh0 s GLN 105 CO 0.75 -2.05 1.69 0.27 -0.25 0.00 0.00 175.29 175.70 2fh0 n ASN 106 N -3.62 3.83 -4.52 5.90 0.23 -1.26 -4.92 115.26 110.91 2fh0 n ASN 106 Ca 0.09 -3.19 -0.32 0.00 -0.53 0.00 0.00 54.58 50.63 2fh0 n ASN 106 Cb 0.60 -0.75 -0.12 0.00 -2.08 0.00 0.00 39.78 37.43 2fh0 n ASN 106 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2fh0 s SER 107 N -0.80 4.22 -0.30 0.53 1.04 -1.26 -5.11 113.70 112.02 2fh0 s SER 107 Ca 0.45 -0.20 -0.04 0.00 0.48 0.00 0.00 55.95 56.64 2fh0 s SER 107 Cb 0.38 -0.91 0.17 0.00 0.10 0.00 0.00 66.02 65.77 2fh0 s SER 107 CO 0.10 0.32 0.64 -1.58 0.98 0.00 0.00 173.24 173.69 2fh0 s GLN 108 N -1.05 0.55 0.37 4.02 0.74 -1.26 -4.76 119.66 118.27 2fh0 s GLN 108 Ca 0.14 1.08 -0.14 0.00 0.05 0.00 0.00 55.36 56.48 2fh0 s GLN 108 Cb -0.11 0.62 -0.08 0.00 1.10 0.00 0.00 33.01 34.54 2fh0 s GLN 108 CO 0.03 -0.49 0.79 -0.80 -0.55 0.00 0.00 175.29 174.26 2fh0 s ASN 109 N 2.87 6.70 0.27 6.67 0.01 -1.26 -5.08 114.94 125.12 2fh0 s ASN 109 Ca 0.13 1.30 -0.00 0.00 -0.71 0.00 0.00 52.86 53.58 2fh0 s ASN 109 Cb -0.14 -2.38 -0.04 0.00 0.41 0.00 0.00 41.25 39.10 2fh0 s ASN 109 CO -0.20 -0.31 0.46 0.20 -1.51 0.00 0.00 177.10 175.75 2fh0 s ASN 110 N -2.58 6.35 0.15 -1.22 -0.87 -1.26 -5.01 114.94 110.51 2fh0 s ASN 110 Ca 0.54 0.41 0.00 0.00 -1.57 0.00 0.00 52.86 52.25 2fh0 s ASN 110 Cb -0.10 -2.01 0.00 0.00 -0.02 0.00 0.00 41.25 39.12 2fh0 s ASN 110 CO 0.22 -0.16 0.00 -1.54 -2.57 0.00 0.00 177.10 173.05 2fh0 n SER 111 N -1.20 -0.96 -2.13 -1.22 3.41 -1.26 -4.93 113.62 105.33 2fh0 n SER 111 Ca -0.05 0.28 -0.15 0.00 -0.26 0.00 0.00 58.87 58.69 2fh0 n SER 111 Cb 0.55 1.11 0.25 0.00 -0.26 0.00 0.00 64.21 65.85 2fh0 n SER 111 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2fh0 n LYS 112 N -2.87 3.04 -0.01 4.33 5.02 -1.26 -4.29 118.16 122.12 2fh0 n LYS 112 Ca 0.00 -3.04 -0.01 0.00 -2.02 0.00 0.00 58.31 53.24 2fh0 n LYS 112 Cb 0.00 -2.20 -0.01 0.00 -0.02 0.00 0.00 35.03 32.80 2fh0 n LYS 112 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2fh0 n ILE 113 N -0.62 0.09 0.14 -0.18 5.41 -1.26 -4.68 119.36 118.26 2fh0 n ILE 113 Ca 0.50 -0.03 0.19 0.00 1.00 0.00 0.00 62.75 64.41 2fh0 n ILE 113 Cb 1.53 -0.72 0.78 0.00 -0.71 0.00 0.00 39.64 40.53 2fh0 n ILE 113 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 176.55 176.71 2fh0 h ILE 114 N -0.01 0.43 -0.98 1.39 3.07 -1.93 -1.50 117.51 117.98 2fh0 h ILE 114 Ca -0.03 0.00 0.12 0.00 1.55 0.00 0.00 64.86 66.50 2fh0 h ILE 114 Cb 1.05 0.73 -0.08 0.00 -0.27 0.00 0.00 36.82 38.25 2fh0 h ILE 114 CO -0.01 0.00 0.62 0.15 -1.05 0.00 0.00 178.15 177.86 2fh0 h PHE 115 N 0.00 1.08 -0.03 0.16 3.04 -1.83 -3.52 116.94 115.84 2fh0 h PHE 115 Ca 0.15 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.13 2fh0 h PHE 115 Cb 0.82 -0.34 0.00 0.00 2.56 0.00 0.00 35.95 38.98 2fh0 h PHE 115 CO 0.00 0.42 0.00 0.39 -2.02 0.00 0.00 178.31 177.10